N-[(5-chloranylpyridin-2-yl)carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[(5-chloranylpyridin-2-yl)carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[(5-chloro-2-pyridyl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[(5-chloro-2-pyridinyl)amino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[(5-chloropyridin-2-yl)carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[(5-chloro-2-pyridyl)thiocarbamoyl]adamantane-1-carboxamide Formula: C17H20ClN3OS MolecularWeight: 349.8782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C17H20ClN3OS/c18-13-1-2-14(19-9-13)20-16(23)21-15(22)17-6-10-3-11(7-17)5-12(4-10)8-17/h1-2,9-12H,3-8H2,(H2,19,20,21,22,23)